SCHEMBL3671458

SCHEMBL3671458

O[C@H]1C[C@@H](N2CCN(C3CCCC3)CC2)C1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 1/20 0.45
MGLL Q99685 1/20 0.45
LMNA P02545 1/20 0.42
CYP2C9 P11712 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SIGMAR1 Q99720 3/20 0.41
L3MBTL3 Q96JM7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HRH3 Q9Y5N1 3/20 0.37
KCNH2 Q12809 2/20 0.37
TSHR P16473 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3671457 1.00 PHGDH (0.45) PHGDHMGLLLMNACYP2C9MEN1
SCHEMBL3631897 0.81 LMNA (0.42) LMNACYP2C9MEN1KMT2APOLB
SCHEMBL3631901 0.81 LMNA (0.42) LMNACYP2C9MEN1KMT2APOLB
SCHEMBL13942560 0.81 PHGDH (0.52) PHGDHMGLLMEN1KMT2APOLB
SCHEMBL19034085 0.81
SCHEMBL987309 0.79 TSHR (0.47) PHGDHMGLLMEN1KMT2APOLB
SCHEMBL2115057 0.79 CYP2C9 (0.46) LMNACYP2C9MEN1KMT2ATSHR
SCHEMBL1431972 0.79 LMNA (0.40) LMNACYP2C9POLBL3MBTL3L3MBTL1
SCHEMBL1431971 0.79 LMNA (0.40) LMNACYP2C9POLBL3MBTL3L3MBTL1
SCHEMBL3750471 0.79 LMNA (0.40) LMNACYP2C9POLBL3MBTL3L3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100292188-A1 Compounds Comprising A Cyclobutoxy Group UCB PHARMA S.A. (BE) 2010-11-18 US disclosed
EP-2238144-A1 COMPOUNDS COMPRISING A CYCLOBUTOXY GROUP UCB Pharma, S.A. (BE) 2010-10-13 EP disclosed
WO-2009092764-A1 COMPOUNDS COMPRISING A CYCLOBUTOXY GROUP UCB PHARMA, S.A. (BE) 2009-07-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100292188-A1 Compounds Comprising A Cyclobutoxy Group CYP11B2, CYP11B1, CYP4B1 PHGDH 1171/4885MGLL 1131/4885LMNA 2612/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.